Organic phosphonic acids and derivatives
Fosfomycin Disodium Salt, TRC
CAS: 26016-99-9 Molecular Formula: C3 H5 O4 P . 2 Na Molecular Weight (g/mol): 182.02 Synonym: Fosfomycin sodium,Disodium (2R,3S)-(3-methyloxiran-2-yl)phosphonate IUPAC Name: disodium;[(2R,3S)-3-methyloxiran-2-yl]-dioxido-oxo-λ^{5}-phosphane SMILES: [Na+].[Na+].C[C@@H]1O[C@@H]1P(=O)([O-])[O-]
Phosphonomethanol, TRC
CAS: 2617-47-2 Molecular Formula: C H5 O4 P Molecular Weight (g/mol): 112.02 Synonym: Phosphonic acid, (hydroxymethyl)- (6CI,7CI,8CI,9CI),P-(Hydroxymethyl)phosphonic acid,(Hydroxymethyl)phosphonate,(Hydroxymethyl)phosphonic acid,Hydroxymethanephosphonic acid,Methanehydroxyphosphonic acid,NSC 41905,NSC 63035,Phosphonomethanol IUPAC Name: hydroxymethylphosphonic acid SMILES: OCP(=O)(O)O
Incandronate, TRC
CAS: 124351-85-5 Molecular Formula: C8H19NO6P2 Molecular Weight (g/mol): 287.19 Synonym: P,P'-[(Cycloheptylamino)methylene]bisphosphonic Acid,[(Cycloheptylamino)methylene]bisphosphonic Acid,Cimadronate,Cimadronic Acid,Icandronate,Incadronic Acid,[(Cycloheptylamino)methylene]bis(phosphonic acid),[(Cycloheptylamino)methylene]diphosphonic Acid IUPAC Name: [(cycloheptylamino)-phosphonomethyl]phosphonic acid SMILES: OP(=O)(O)C(NC1CCCCCC1)P(=O)(O)O
DOTP, TRC
CAS: 91987-74-5 Molecular Formula: C12H32N4O12P4 Molecular Weight (g/mol): 548.3 Synonym: 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetra(methylene Phosphonic Acid),1,4,7,10-Tetraazacyclododecane, Phosphonic Acid deriv.,1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetramethylenephosphonic Acid,DOTMP,NSC 681106,N,N',N'',N'''-Tetrakis(phosphonomethyl)-1,4,7,10-tetraazacyclododecane SMILES: OP(=O)(O)CN1CCN(CP(=O)(O)O)CCN(CP(=O)(O)O)CCN(CP(=O)(O)O)CC1
Etidronate, TRC
CAS: 2809-21-4 Molecular Formula: C2 H8 O7 P2 Molecular Weight (g/mol): 206.028 Synonym: Phosphonic acid, P,P'-(1-hydroxyethylidene)bis-,Phosphonic acid, (1-hydroxyethylidene)bis- (9CI),Phosphonic acid, (1-hydroxyethylidene)di- (8CI),P,P'-(1-Hydroxyethylidene)bis[phosphonic acid\],(1-Hydroxyethylidene)-1,1-bis(phosphonic acid),(1-Hydroxyethylidene)-1,1-diphosphonic acid,(1-Hydroxyethylidene)bisphosphonic acid,(1-Hydroxyethylidene)diphosphonic acid,1-Hydroxy-1,1-diphosphonoethane,1-Hydroxyethane-1,1-bisphosphonic acid,1-Hydroxyethane-1,1-diphosphonic acid,1-Hydroxyethane-1,1-diyldiphosphonic acid,1-Hydroxyethanediphosphonic acid,1-Hydroxyethylidene-1,1-diphoshonic acid,1-Hydroxyethylidene-1,1-diphosphoric acid,1-Hydroxyethylidene-1,1'-diphosphonic acid,1000SL,Acetodiphosphonic acid,Acidum etidronicum,Anti Cal 5,Aquacid 105,Aquacid 105CG,Aquacid 105EX,Aquacid 105EXLC,Aquacid 105EXSP,Aquacid 105NS,Belclene 660,Briquest ADPA 60A,Briquest ADPA-A,Chelate 101,Chelest PH 210L,Cublen K 60,Defloc EH 06,Dequest 16,Dequest 2010,Dequest 2010CS,Dequest 2010LA,Dequest 2010R,Dequest 2015,Dequest D 2010,Dequest Z 010,EHDP,Ethane-1-hydroxy-1,1-diphosphonic acid,Ethidronate,Ethydronate,Etidronate,Etidronic acid,Feliox 115,Feliox 115A,Feliox CY 115,Ferrofos 510,H 501,H 501 (corrosion inhibitor),HDEPA,HEDP,Hydroxyethanediphosphonic acid,Kochtreat 75,Ksidifon,Lonza 106,Mascol P 210,Masquol P 210,Mayoquest 1500,NSC 227995,OEDF,OEDFK,OEDP,Oxyethylidenediphosphonic acid,RP 61,Sequion 10H,Sone 16,Tecquest 360,Terpil SL,Turpinal SL,Turpinal SLR,Unihib 106,Wayplex,Xidifon,Xidiphone,Xydiphone IUPAC Name: (1-hydroxy-1-phosphonoethyl)phosphonic acid SMILES: CC(O)(P(=O)(O)O)P(=O)(O)O
Fosfomycin Calcium, TRC
CAS: 26016-98-8 Molecular Formula: C3 H5 O4 P . Ca Molecular Weight (g/mol): 176.12 Synonym: Phosphonic acid, (1,2-epoxypropyl)-, calcium salt (1:1), (1R,2S)-(-)- (8CI),Phosphonic acid, (3-methyloxiranyl)-, calcium salt (1:1), (2R-cis)-,Phosphonic acid, [(2R,3S)-3-methyloxiranyl]-, calcium salt (1:1) (9CI),Calcium fosfomycin,Calcium phosphomycin,Calcium phosphonomycin,Fosfomycin calcium,Fosfomycin calcium salt,Fosfomycin calcium salt (1:1),Fosmicin,Levo-phosphonomycin calcium salt,Phosphonomycin calcium salt IUPAC Name: calcium;[(2R,3S)-3-methyloxiran-2-yl]-dioxido-oxo-λ^{5}-phosphane SMILES: [Ca+2].C[C@@H]1O[C@@H]1P(=O)([O-])[O-]
Tetraisopropyl Methylenediphosphonate, TRC
CAS: 1660-95-3 Molecular Formula: C13 H30 O6 P2 Molecular Weight (g/mol): 344.32 Synonym: P,P'-Methylenebisphosphonic acid,Phosphonic acid, methylenebis-, tetrakis(1-methylethyl) ester (9CI),Phosphonic acid, methylenedi-, tetraisopropyl ester (7CI,8CI),Methylenediphosphonic acid tetraisopropyl ester,NSC 226577,Tetraisopropyl methylenebisphosphonate,Tetraisopropyl methylenediphosphonate,Tetrakis(O-isopropyl) methylenediphosphonate,[(Diisopropoxyphosphinyl)methyl]diisopropoxyphosphine oxide IUPAC Name: 2-[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]oxypropane SMILES: CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C
Triethyl Phosphonoacetate, TRC
CAS: 867-13-0 Molecular Formula: C8 H17 O5 P Molecular Weight (g/mol): 224.19 Synonym: Phosphonoacetic Acid-Triethyl Ester,Acetic acid, (diethoxyphosphinyl)-, ethyl ester (9CI),Acetic acid, phosphono-, triethyl ester (6CI,7CI,8CI),(Diethoxyphosphinyl)acetic acid ethyl ester,(Diethoxyphosphoryl)acetic acid ethyl ester,(Ethoxycarbonylmethyl)diethoxyphosphine oxide,2-Phosphonoacetic acid triethyl ester,Carbethoxymethyldiethyl phosphonate,Diethyl 2-ethoxy-2-oxoethylphosphonate,Diethyl carbethoxymethylphosphonate,Diethyl ethoxycarbonylmethanephosphonate,Diethyl phosphonoacetic acid ethyl ester,Ethyl (diethoxyphosphinyl)acetate,Ethyl (diethylphosphono)acetate,Ethyl 2-(diethoxylphosphoryl)acetate,Ethyl 2-(diethoxyphosphinyl)acetate,Ethyl 2-(diethoxyphosphoryl)acetate,Ethyl 2-(diethylphosphono)acetate,Ethyl diethoxyphosphoryl acetate,Ethyl α-diethylphosphonoacetate,JC 224,NSC 13898,NSC 16128,Phosphonoacetic acid triethyl ester,Triethyl 2-phosphonoacetate,Triethyl phosphonacetate,Triethyl phosphonoacetate IUPAC Name: ethyl 2-diethoxyphosphorylacetate SMILES: CCOC(=O)CP(=O)(OCC)OCC
Tetraethyl Methylidenebisphosphonate, TRC
CAS: 1660-94-2 Molecular Formula: C9H22O6P2 Molecular Weight (g/mol): 288.21 Synonym: P,P'-Methylenebisphosphonic Acid P,P,P',P'-Tetraethyl Ester,Methylenebisphosphonic Acid Tetraethyl Ester,Bis(diethylphosphono)methane,Methylenebis(diethoxyphosphine oxide),Methylenebis(diethyl phosphonate),Methylenebis(phosphonic acid) tetraethyl Ester,Tetraethyl methylenediphosphonate IUPAC Name: 1-[diethoxyphosphorylmethyl(ethoxy)phosphoryl]oxyethane SMILES: CCOP(=O)(CP(=O)(OCC)OCC)OCC
Aminomethanephosphonic Acid, TRC
CAS: 1066-51-9 Molecular Formula: C H6 N O3 P Molecular Weight (g/mol): 111.04 Synonym: Phosphonic acid, (aminomethyl)- (6CI,7CI,8CI,9CI),P-(Aminomethyl)phosphonic acid,(Aminomethyl)phosphonic acid,AMPA,AMPA (surfactant),Aminomethanephosphonic acid,Aminomethylenephosphonic acid,NSC 30076,Nalco 3919,Phosphaglycine IUPAC Name: aminomethylphosphonic acid SMILES: NCP(=O)(O)O
Pamidronic Acid, TRC
CAS: 40391-99-9 Molecular Formula: C3 H11 N O7 P2 Molecular Weight (g/mol): 235.07 Synonym: Phosphonic acid, P,P'-(3-amino-1-hydroxypropylidene)bis-,Phosphonic acid, (3-amino-1-hydroxypropylidene)bis- (9CI),P,P'-(3-Amino-1-hydroxypropylidene)bis[phosphonic acid],(3-Amino-1-hydroxypropylidene)-1,1-bisphosphonate,(3-Amino-1-hydroxypropylidene)bisphosphonic acid,(α-Hydroxy-γ-aminopropylidene)diphosphonic acid,1-Hydroxy-3-aminopropane-1,1-diphosphonic acid,3-Amino-1-hydroxypropane-1,1-diphosphonic acid,3-Amino-1-hydroxypropylidene-1,1-bisphosphonic acid,3-Amino-1-hydroxypropylidenediphosphonic acid,ADP,AHPrBP,Amidronic acid,BPH 5,Pamidronic acid,Panolin,Propane-1-hydroxy-3-amino-1,1-diphosphonic acid IUPAC Name: (3-amino-1-hydroxy-1-phosphonopropyl)phosphonic acid SMILES: NCCC(O)(P(=O)(O)O)P(=O)(O)O
Ibandronic Acid, TRC
CAS: 114084-78-5 Molecular Formula: C9 H23 N O7 P2 Molecular Weight (g/mol): 319.23 Synonym: Phosphonic acid, P,P'-[1-hydroxy-3-(methylpentylamino)propylidene]bis- (ACI),P,P'-[1-Hydroxy-3-(methylpentylamino)propylidene]bis[phosphonic acid] (ACI),Phosphonic acid, [1-hydroxy-3-(methylpentylamino)propylidene]bis- (9CI),(1-Hydroxy-3-(methyl(pentyl)amino)propane-1,1-diyl)diphosphonicacid,[1-Hydroxy-3-(methylpentylamino)propylidene]diphosphonic acid,[1-Hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl]phosphonic acid,Bondenza,BPH 24,Destara,Iasibon,Ibandronate,Ibandronic acid IUPAC Name: [1-hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl]phosphonic acid SMILES: CCCCCN(C)CCC(O)(P(=O)(O)O)P(=O)(O)O
Medronic Acid, TRC
CAS: 1984-15-2 Molecular Formula: C H6 O6 P2 Molecular Weight (g/mol): 176 Synonym: Medronic acid,Methylenediphosphonic acid,P,P'-Methylenebisphosphonic acid,Phosphonic acid, methylenebis- (9CI),Phosphonic acid, methylenedi- (6CI,7CI,8CI),MDP,Medronate,Medronic acid,Methanebisphosphonic acid,Methanediphosphonic acid,Methylene-1,1-bisphosphonic acid,Methylenebis[phosphonic acid],Methylenediphosphonic acid IUPAC Name: phosphonomethylphosphonic acid SMILES: OP(=O)(O)CP(=O)(O)O
Tetraethyl Ethylenephosphonate, TRC
CAS: 995-32-4 Molecular Formula: C10H24O6P2 Molecular Weight (g/mol): 302.24 Synonym: Phosphonic acid, P,P'-1,2-ethanediylbis-, P,P,P',P'-tetraethyl ester,Phosphonic acid, 1,2-ethanediylbis-, tetraethyl ester (9CI),Phosphonic acid, ethylenedi-, tetraethyl ester (6CI,7CI,8CI),1,2-Bis(diethoxyphosphinyl)ethane,1,2-Bis(diethoxyphosphoryl)ethane,1,2-Bis(diethylphosphonyl)ethane,1,2-Ethylenediphosphonic acid tetraethyl ester,Ethane-1,2-diphosphonic acid tetraethyl ester,Tetraethyl ethylenebis(phosphonate),Tetraethyl ethylenediphosphonate IUPAC Name: 1,2-bis(diethoxyphosphoryl)ethane SMILES: CCOP(=O)(CCP(=O)(OCC)OCC)OCC
Risedronic Acid, TRC
CAS: 105462-24-6 Molecular Formula: C7 H11 N O7 P2 Molecular Weight (g/mol): 283.11 Synonym: Phosphonic acid, P,P'-[1-hydroxy-2-(3-pyridinyl)ethylidene]bis-,Phosphonic acid, [1-hydroxy-2-(3-pyridinyl)ethylidene]bis- (9CI),P,P'-[1-Hydroxy-2-(3-pyridinyl)ethylidene]bis[phosphonic acid],1-Hydroxy-2-(3-pyridinyl)ethylidene bisphosphonic acid,1-Hydroxy-2-(3-pyridyl)ethylidene-1,1-diphosphonic acid,1-Hydroxy-2-pyrid-3-ylethylidene-1,1-bisphosphonic acid,BPH 2,NE 58019,Risedronate,Risedronic acid IUPAC Name: (1-hydroxy-1-phosphono-2-pyridin-3-ylethyl)phosphonic acid SMILES: OC(Cc1cccnc1)(P(=O)(O)O)P(=O)(O)O